1-pyrrolidin-1-yl-3-[(3R)-1-(thian-4-yl)piperidin-1-ium-3-yl]propan-1-one

Systemtic Name: 1-pyrrolidin-1-yl-3-[(3R)-1-(thian-4-yl)piperidin-1-ium-3-yl]propan-1-one Openeye Name: 1-pyrrolidin-1-yl-3-[(3R)-1-tetrahydrothiopyran-4-ylpiperidin-1-ium-3-yl]propan-1-one CAS Name: 1-(1-pyrrolidinyl)-3-[(3R)-1-(4-thianyl)-3-piperidin-1-iumyl]-1-propanone IUPAC Name: 1-pyrrolidin-1-yl-3-[(3R)-1-(thian-4-yl)piperidin-1-ium-3-yl]propan-1-one Traditional Name: 1-pyrrolidino-3-[(3R)-1-tetrahydrothiopyran-4-ylpiperidin-1-ium-3-yl]propan-1-one Formula: C17H31N2OS+ MolecularWeight: 311.50584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CCC2CCC[NH+](C2)C3CCSCC3

Isomeric SMILES

C1CCN(C1)C(=O)CC[C@H]2CCC[NH+](C2)C3CCSCC3

InChI

InChI=1S/C17H30N2OS/c20-17(18-9-1-2-10-18)6-5-15-4-3-11-19(14-15)16-7-12-21-13-8-16/h15-16H,1-14H2/p+1/t15-/m1/s1